4,5-bis(oxidanyl)-2-[4-[2-(pentylsulfanylmethyl)phenyl]but-3-ynyl]furan-3-one

Systemtic Name: 4,5-bis(oxidanyl)-2-[4-[2-(pentylsulfanylmethyl)phenyl]but-3-ynyl]furan-3-one Openeye Name: 4,5-dihydroxy-2-[4-[2-(pentylsulfanylmethyl)phenyl]but-3-ynyl]furan-3-one CAS Name: 4,5-dihydroxy-2-[4-[2-[(pentylthio)methyl]phenyl]but-3-ynyl]-3-furanone IUPAC Name: 4,5-dihydroxy-2-[4-[2-(pentylsulfanylmethyl)phenyl]but-3-ynyl]furan-3-one Traditional Name: 2-[4-[2-[(amylthio)methyl]phenyl]but-3-ynyl]-4,5-dihydroxy-furan-3-one Formula: C20H24O4S MolecularWeight: 360.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSCC1=CC=CC=C1C#CCCC2C(=O)C(=C(O2)O)O

Isomeric SMILES

CCCCCSCC1=CC=CC=C1C#CCCC2C(=O)C(=C(O2)O)O

InChI

InChI=1S/C20H24O4S/c1-2-3-8-13-25-14-16-11-5-4-9-15(16)10-6-7-12-17-18(21)19(22)20(23)24-17/h4-5,9,11,17,22-23H,2-3,7-8,12-14H2,1H3